Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 4/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11702303 | 0.81 | CYP17A1 (0.42) | CYP17A1CYP3A4CYP2D6CYP1A2CYP19A1 | |
| SCHEMBL11449340 | 0.80 | ADRA2C (0.45) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL27807003 | 0.79 | ADRA2C (0.56) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL20640452 | 0.79 | ADRA2C (0.52) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL8447278 | 0.79 | ADRA2C (0.56) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL27807071 | 0.79 | ADRA2C (0.56) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL9586874 | 0.79 | ADRA2C (0.50) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL11456948 | 0.79 | ADRA2C (0.59) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL11467588 | 0.79 | ADRA2C (0.59) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 | |
| SCHEMBL23803981 | 0.78 | ADRA2C (0.51) | CYP17A1ADRA2CCYP3A4CYP2D6CYP1A2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4237158-A | FOR PLANT DISEASES; PLANT GROWTH REGULATORS | ROHM AND HAAS COMPANY (US) | 1980-12-02 | — | — | US | disclosed |
| US-4118461-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1978-10-03 | — | — | US | disclosed |
| US-4115578-A | FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1978-09-19 | — | — | US | disclosed |
| US-4105762-A | Metal salt complexes of 1-substituted aralkyl imidazoles, and methods and compositions for controlling phytopathogenic fungi using them | ROHM AND HAAS COMPANY (US) | 1978-08-08 | — | — | US | disclosed |